CID 6234

D-cycloserine

Structural Information

Molecular Formula

C₃H₆N₂O₂

SMILES

C1[C@H](C(=O)NO1)N

InChI

InChI=1S/C3H6N2O2/c4-2-1-7-5-3(2)6/h2H,1,4H2,(H,5,6)/t2-/m1/s1

InChIKey

DYDCUQKUCUHJBH-UWTATZPHSA-N

Compound name

(4R)-4-amino-1,2-oxazolidin-3-one

Related CIDs

2D Structure

compound 2d structure

9
Annotation Hits: 3102
References: 32967
Patents: 102.04293 Da
Monoisotopic Mass: -1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	103.05021	116.6
[M+Na]+	125.03215	124.2
[M-H]-	101.03565	117.7
[M+NH4]+	120.07675	137.5
[M+K]+	141.00609	124.3
[M+H-H2O]+	85.040190	111.1
[M+HCOO]-	147.04113	138.1
[M+CH3COO]-	161.05678	162.4
[M+Na-2H]-	123.01760	122.6
[M]+	102.04238	112.1
[M]-	102.04348	112.1

Literature stripe

literature stripe

Patent stripe

patents stripe